573973-85-0
Product Name:
(E)-methyl 4-(((2-amino-3-(heptylcarbamoyl)-1H-pyrrolo[2,3-b]quinoxalin-1-yl)imino)methyl)benzoate
Formula:
C27H30N6O3
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COMPUTED DESCRIPTORS
| Molecular Weight | 486.6 g/mol |
|---|---|
| XLogP3 | 5.4 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 11 |
| Exact Mass | 486.23793884 g/mol |
| Monoisotopic Mass | 486.23793884 g/mol |
| Topological Polar Surface Area | 125 Ų |
| Heavy Atom Count | 36 |
| Formal Charge | 0 |
| Complexity | 756 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |